EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:217740 - 10-formamido-kalihinol F

ChEBI IDCHEBI:217740
ChEBI Name10-formamido-kalihinol F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H39N3O3
Net Charge0
Average Mass405.583
Monoisotopic Mass405.29914
SMILESC=N[C@@H]1[C@@H]2[C@@H]([C@@]3(C)CC[C@@H](C(C)(C)N=C)O3)CC[C@](C)(NC=O)[C@H]2CC[C@@]1(C)O
InChIInChI=1S/C23H39N3O3/c1-20(2,25-7)17-10-13-23(5,29-17)16-8-11-21(3,26-14-27)15-9-12-22(4,28)19(24-6)18(15)16/h14-19,28H,6-13H2,1-5H3,(H,26,27)/t15-,16-,17-,18-,19+,21-,22+,23+/m0/s1
InChIKeyNJOQQBBIDBZRSL-DKNXKHEBSA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - DOI (10.1016/j.tet.2003.08.082)
ChEBI Ontology
Outgoing Relation(s)
10-formamido-kalihinol F (CHEBI:217740) is a diterpenoid (CHEBI:23849)
IUPAC Name 
N-[(1S,4S,4aS,5R,6R,8aS)-6-hydroxy-1,6-dimethyl-5-(methylideneamino)-4-[(2R,5S)-2-methyl-5-[2-(methylideneamino)propan-2-yl]oxolan-2-yl]-2,3,4,4a,5,7,8,8a-octahydronaphthalen-1-yl]ormamide
Manual XrefsDatabases
78440391ChemSpider